Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 3/20 | 0.39 |
| ▸ | GRIK2 | Q13002 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | SLC7A11 | Q9UPY5 | 1/20 | 0.31 |
| ▸ | CPA1 | P15085 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9018560 | 0.74 | ALDH1A1 (0.37) | GRIK1GRIK2ALDH1A1CYP2C19LMNA | |
| SCHEMBL10886922 | 0.73 | ALDH1A1 (0.35) | GRIK1GRIK2ALDH1A1CYP2C19SLC6A2 | |
| SCHEMBL2550190 | 0.73 | SMPD2 (0.41) | GRIK1GRIK2ALDH1A1MEN1TSHR | |
| SCHEMBL2557862 | 0.71 | GRIK1 (0.38) | GRIK1GRIK2ALDH1A1CYP2C19LMNA | |
| SCHEMBL29817200 | 0.71 | SMPD2 (0.42) | GRIK1GRIK2ALDH1A1LMNA | |
| SCHEMBL7166741 | 0.71 | GRIK1 (0.32) | GRIK1GRIK2ALDH1A1 | |
| SCHEMBL1049789 | 0.71 | KMT2A (0.34) | GRIK1GRIK2ALDH1A1CYP2C19SLC6A2 | |
| Hydrochloric Acid SCHEMBL4943209 | 0.70 | KMT2A (0.33) | GRIK1GRIK2ALDH1A1CYP2C19SLC6A2 | |
| SCHEMBL4541470 | 0.70 | ALDH1A1 (0.33) | ALDH1A1LMNAPTGS1SLC7A11 | |
| SCHEMBL4541471 | 0.70 | ALDH1A1 (0.33) | ALDH1A1LMNAPTGS1SLC7A11 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009100996-A2 | PROCESS FOR PREPARING PYRAZOLE FUNCTIONALIZED BENZODIAZEPINONES | F. HOFFMANN-LA ROCHE AG (CH) | 2009-08-20 | — | — | WO | disclosed |
| US-20090203901-A1 | Process for preparing pyrazole functionalized benzodiazepinones | ROCHE COLORADO CORPORATION | 2009-08-13 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20090203901-A1 | Process for preparing pyrazole functionalized benzodiazepinones | AANAT, MAOB, ADRA1B | GRIK1 120/4885GRIK2 139/4885ALDH1A1 333/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.